CAO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1A | C2A | sing | 1.32Å | 1.33Å | Aromatic |
| N1A | C6A | doub | 1.33Å | 1.34Å | Aromatic |
| C2A | N3A | doub | 1.32Å | 1.33Å | Aromatic |
| C2A | H2A | sing | 1.08Å | 1.10Å | |
| N3A | C4A | sing | 1.33Å | 1.34Å | Aromatic |
| C4A | C5A | doub | 1.41Å | 1.37Å | Aromatic |
| C4A | N9A | sing | 1.37Å | 1.33Å | Aromatic |
| C5A | C6A | sing | 1.40Å | 1.39Å | Aromatic |
| C5A | N7A | sing | 1.36Å | 1.32Å | Aromatic |
| C6A | N6A | sing | 1.38Å | 1.32Å | |
| N6A | H61A | sing | 0.97Å | 1.02Å | |
| N6A | H62A | sing | 0.97Å | 1.02Å | |
| N7A | C8A | doub | 1.30Å | 1.34Å | Aromatic |
| C8A | N9A | sing | 1.36Å | 1.34Å | Aromatic |
| C8A | H8A | sing | 1.08Å | 1.10Å | |
| N9A | C1B | sing | 1.46Å | 1.48Å | |
| C1B | C2B | sing | 1.55Å | 1.53Å | |
| C1B | O4B | sing | 1.44Å | 1.45Å | |
| C1B | H1B | sing | 1.09Å | 1.12Å | |
| C2B | O2B | sing | 1.43Å | 1.44Å | |
| C2B | C3B | sing | 1.55Å | 1.51Å | |
| C2B | H2B | sing | 1.09Å | 1.11Å | |
| O2B | HO2A | sing | 0.97Å | 0.95Å | |
| C3B | O3B | sing | 1.43Å | 1.43Å | |
| C3B | C4B | sing | 1.54Å | 1.52Å | |
| C3B | H3B | sing | 1.09Å | 1.12Å | |
| O3B | P3B | sing | 1.61Å | 1.63Å | |
| P3B | O7A | doub | 1.48Å | 1.50Å | |
| P3B | O8A | sing | 1.61Å | 1.49Å | |
| P3B | O9A | sing | 1.61Å | 1.49Å | |
| O8A | HOA8 | sing | 0.97Å | 0.95Å | |
| O9A | HOA9 | sing | 0.97Å | 0.95Å | |
| C4B | O4B | sing | 1.44Å | 1.43Å | |
| C4B | C5B | sing | 1.53Å | 1.50Å | |
| C4B | H4B | sing | 1.09Å | 1.11Å | |
| C5B | O5B | sing | 1.43Å | 1.41Å | |
| C5B | H51A | sing | 1.09Å | 1.11Å | |
| C5B | H52A | sing | 1.09Å | 1.12Å | |
| O5B | P1A | sing | 1.61Å | 1.61Å | |
| P1A | O1A | doub | 1.48Å | 1.48Å | |
| P1A | O2A | sing | 1.61Å | 1.48Å | |
| P1A | O3A | sing | 1.61Å | 1.60Å | |
| O2A | HOA2 | sing | 0.97Å | 0.95Å | |
| O3A | P2A | sing | 1.61Å | 1.59Å | |
| P2A | O4A | doub | 1.48Å | 1.48Å | |
| P2A | O5A | sing | 1.61Å | 1.48Å | |
| P2A | O6A | sing | 1.61Å | 1.63Å | |
| O5A | HOA5 | sing | 0.97Å | 0.95Å | |
| O6A | CCP | sing | 1.43Å | 1.44Å | |
| CBP | CCP | sing | 1.53Å | 1.54Å | |
| CBP | CDP | sing | 1.53Å | 1.52Å | |
| CBP | CEP | sing | 1.53Å | 1.51Å | |
| CBP | CAP | sing | 1.53Å | 1.55Å | |
| CCP | H121 | sing | 1.09Å | 1.12Å | |
| CCP | H122 | sing | 1.09Å | 1.11Å | |
| CDP | H131 | sing | 1.09Å | 1.11Å | |
| CDP | H132 | sing | 1.09Å | 1.11Å | |
| CDP | H133 | sing | 1.09Å | 1.11Å | |
| CEP | H141 | sing | 1.09Å | 1.11Å | |
| CEP | H142 | sing | 1.09Å | 1.12Å | |
| CEP | H143 | sing | 1.09Å | 1.11Å | |
| CAP | OAP | sing | 1.43Å | 1.44Å | |
| CAP | C9P | sing | 1.51Å | 1.56Å | |
| CAP | H10 | sing | 1.09Å | 1.12Å | |
| OAP | HO1 | sing | 0.97Å | 0.95Å | |
| C9P | O9P | doub | 1.21Å | 1.24Å | |
| C9P | N8P | sing | 1.35Å | 1.35Å | |
| N8P | C7P | sing | 1.46Å | 1.46Å | |
| N8P | HN8 | sing | 0.97Å | 1.02Å | |
| C7P | C6P | sing | 1.53Å | 1.53Å | |
| C7P | H71 | sing | 1.09Å | 1.11Å | |
| C7P | H72 | sing | 1.09Å | 1.11Å | |
| C6P | C5P | sing | 1.51Å | 1.53Å | |
| C6P | H61 | sing | 1.09Å | 1.11Å | |
| C6P | H62 | sing | 1.09Å | 1.12Å | |
| C5P | O5P | doub | 1.21Å | 1.24Å | |
| C5P | N4P | sing | 1.35Å | 1.35Å | |
| N4P | C3P | sing | 1.47Å | 1.47Å | |
| N4P | HN4 | sing | 0.97Å | 1.02Å | |
| C3P | C2P | sing | 1.53Å | 1.50Å | |
| C3P | H31 | sing | 1.09Å | 1.12Å | |
| C3P | H32 | sing | 1.09Å | 1.11Å | |
| C2P | S1P | sing | 1.81Å | 1.80Å | |
| C2P | H21 | sing | 1.09Å | 1.11Å | |
| C2P | H22 | sing | 1.09Å | 1.11Å | |
| S1P | O1P | sing | 1.52Å | 1.85Å | |
| O1P | HOS1 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2A | N1A | C6A | 119.8° | 121.2° |
| N1A | C2A | N3A | 124.7° | 122.5° |
| N1A | C2A | H2A | 117.8° | 118.7° |
| N1A | C6A | C5A | 115.2° | 118.5° |
| N1A | C6A | N6A | 121.9° | 120.8° |
| N3A | C2A | H2A | 117.6° | 118.7° |
| C2A | N3A | C4A | 119.6° | 120.6° |
| N3A | C4A | C5A | 115.9° | 119.1° |
| N3A | C4A | N9A | 138.4° | 134.9° |
| C5A | C4A | N9A | 105.7° | 106.0° |
| C4A | C5A | C6A | 124.7° | 118.2° |
| C4A | C5A | N7A | 111.2° | 107.1° |
| C4A | N9A | C8A | 107.5° | 107.5° |
| C4A | N9A | C1B | 124.9° | 126.3° |
| C6A | C5A | N7A | 124.0° | 134.7° |
| C5A | C6A | N6A | 122.2° | 120.8° |
| C5A | N7A | C8A | 104.3° | 109.5° |
| C6A | N6A | H61A | 121.9° | 119.9° |
| C6A | N6A | H62A | 107.7° | 120.0° |
| H61A | N6A | H62A | 107.9° | 120.0° |
| N7A | C8A | N9A | 111.2° | 110.0° |
| N7A | C8A | H8A | 124.5° | 125.0° |
| N9A | C8A | H8A | 124.3° | 125.0° |
| C8A | N9A | C1B | 125.8° | 126.3° |
| N9A | C1B | C2B | 109.2° | 110.8° |
| N9A | C1B | O4B | 113.9° | 110.6° |
| N9A | C1B | H1B | 105.7° | 110.6° |
| C2B | C1B | O4B | 106.5° | 103.5° |
| C2B | C1B | H1B | 113.2° | 110.6° |
| C1B | C2B | O2B | 118.1° | 110.9° |
| C1B | C2B | C3B | 99.7° | 102.1° |
| C1B | C2B | H2B | 113.7° | 110.9° |
| O4B | C1B | H1B | 108.4° | 110.6° |
| C1B | O4B | C4B | 105.6° | 107.0° |
| O2B | C2B | C3B | 117.3° | 110.9° |
| O2B | C2B | H2B | 94.4° | 110.8° |
| C2B | O2B | HO2A | 118.1° | 106.8° |
| C3B | C2B | H2B | 114.5° | 110.9° |
| C2B | C3B | O3B | 113.9° | 110.5° |
| C2B | C3B | C4B | 101.1° | 104.0° |
| C2B | C3B | H3B | 113.9° | 110.5° |
| O3B | C3B | C4B | 114.1° | 110.8° |
| O3B | C3B | H3B | 100.7° | 110.5° |
| C3B | O3B | P3B | 119.4° | 106.8° |
| C4B | C3B | H3B | 113.7° | 110.5° |
| C3B | C4B | O4B | 109.1° | 107.5° |
| C3B | C4B | C5B | 97.7° | 109.9° |
| C3B | C4B | H4B | 116.7° | 109.9° |
| O3B | P3B | O7A | 107.2° | 109.5° |
| O3B | P3B | O8A | 103.7° | 109.5° |
| O3B | P3B | O9A | 101.9° | 109.5° |
| O7A | P3B | O8A | 115.7° | 109.5° |
| O7A | P3B | O9A | 113.5° | 109.5° |
| O8A | P3B | O9A | 113.1° | 109.5° |
| P3B | O8A | HOA8 | 103.7° | 106.8° |
| P3B | O9A | HOA9 | 101.9° | 106.8° |
| O4B | C4B | C5B | 109.0° | 109.8° |
| O4B | C4B | H4B | 106.9° | 109.9° |
| C5B | C4B | H4B | 117.0° | 109.8° |
| C4B | C5B | O5B | 119.2° | 109.5° |
| C4B | C5B | H51A | 108.7° | 109.5° |
| C4B | C5B | H52A | 108.7° | 109.4° |
| O5B | C5B | H51A | 108.8° | 109.5° |
| O5B | C5B | H52A | 108.8° | 109.5° |
| C5B | O5B | P1A | 112.6° | 106.8° |
| H51A | C5B | H52A | 101.3° | 109.5° |
| O5B | P1A | O1A | 108.7° | 109.5° |
| O5B | P1A | O2A | 110.4° | 109.4° |
| O5B | P1A | O3A | 99.3° | 109.5° |
| O1A | P1A | O2A | 117.6° | 109.5° |
| O1A | P1A | O3A | 110.7° | 109.5° |
| O2A | P1A | O3A | 108.7° | 109.5° |
| P1A | O2A | HOA2 | 110.4° | 106.8° |
| P1A | O3A | P2A | 136.0° | 106.8° |
| O3A | P2A | O4A | 110.4° | 109.4° |
| O3A | P2A | O5A | 104.3° | 109.5° |
| O3A | P2A | O6A | 102.3° | 109.4° |
| O4A | P2A | O5A | 119.3° | 109.5° |
| O4A | P2A | O6A | 107.4° | 109.5° |
| O5A | P2A | O6A | 111.8° | 109.5° |
| P2A | O5A | HOA5 | 104.4° | 106.9° |
| P2A | O6A | CCP | 123.4° | 106.8° |
| O6A | CCP | CBP | 116.7° | 109.5° |
| O6A | CCP | H121 | 109.5° | 109.5° |
| O6A | CCP | H122 | 109.6° | 109.4° |
| CCP | CBP | CDP | 112.0° | 109.4° |
| CCP | CBP | CEP | 103.4° | 109.5° |
| CCP | CBP | CAP | 112.4° | 109.5° |
| CBP | CCP | H121 | 109.6° | 109.5° |
| CBP | CCP | H122 | 109.6° | 109.4° |
| CDP | CBP | CEP | 107.2° | 109.5° |
| CDP | CBP | CAP | 109.9° | 109.4° |
| CBP | CDP | H131 | 112.0° | 109.5° |
| CBP | CDP | H132 | 111.3° | 109.4° |
| CBP | CDP | H133 | 111.3° | 109.4° |
| CEP | CBP | CAP | 111.6° | 109.5° |
| CBP | CEP | H141 | 103.4° | 109.5° |
| CBP | CEP | H142 | 114.5° | 109.5° |
| CBP | CEP | H143 | 114.5° | 109.5° |
| CBP | CAP | OAP | 109.2° | 109.4° |
| CBP | CAP | C9P | 118.1° | 109.5° |
| CBP | CAP | H10 | 103.1° | 109.5° |
| H121 | CCP | H122 | 100.6° | 109.5° |
| H131 | CDP | H132 | 111.3° | 109.5° |
| H131 | CDP | H133 | 111.4° | 109.5° |
| H132 | CDP | H133 | 99.0° | 109.5° |
| H141 | CEP | H142 | 114.6° | 109.5° |
| H141 | CEP | H143 | 114.5° | 109.4° |
| H142 | CEP | H143 | 96.0° | 109.4° |
| OAP | CAP | C9P | 107.9° | 109.4° |
| OAP | CAP | H10 | 114.2° | 109.5° |
| CAP | OAP | HO1 | 109.2° | 106.8° |
| C9P | CAP | H10 | 104.5° | 109.5° |
| CAP | C9P | O9P | 123.5° | 120.0° |
| CAP | C9P | N8P | 116.5° | 120.0° |
| O9P | C9P | N8P | 119.7° | 120.0° |
| C9P | N8P | C7P | 123.6° | 120.1° |
| C9P | N8P | HN8 | 114.2° | 120.0° |
| C7P | N8P | HN8 | 122.2° | 120.0° |
| N8P | C7P | C6P | 115.4° | 109.5° |
| N8P | C7P | H71 | 110.0° | 109.5° |
| N8P | C7P | H72 | 110.0° | 109.5° |
| C6P | C7P | H71 | 110.0° | 109.5° |
| C6P | C7P | H72 | 110.1° | 109.5° |
| C7P | C6P | C5P | 111.1° | 109.5° |
| C7P | C6P | H61 | 111.6° | 109.5° |
| C7P | C6P | H62 | 111.6° | 109.5° |
| H71 | C7P | H72 | 100.2° | 109.4° |
| C5P | C6P | H61 | 111.7° | 109.5° |
| C5P | C6P | H62 | 111.6° | 109.4° |
| C6P | C5P | O5P | 117.1° | 120.0° |
| C6P | C5P | N4P | 126.2° | 120.0° |
| H61 | C6P | H62 | 98.8° | 109.4° |
| O5P | C5P | N4P | 116.7° | 120.0° |
| C5P | N4P | C3P | 119.4° | 120.0° |
| C5P | N4P | HN4 | 116.2° | 120.1° |
| C3P | N4P | HN4 | 124.5° | 119.9° |
| N4P | C3P | C2P | 117.4° | 109.4° |
| N4P | C3P | H31 | 109.3° | 109.5° |
| N4P | C3P | H32 | 109.3° | 109.4° |
| C2P | C3P | H31 | 109.3° | 109.5° |
| C2P | C3P | H32 | 109.4° | 109.5° |
| C3P | C2P | S1P | 106.5° | 109.4° |
| C3P | C2P | H21 | 113.3° | 109.5° |
| C3P | C2P | H22 | 113.3° | 109.5° |
| H31 | C3P | H32 | 100.8° | 109.5° |
| S1P | C2P | H21 | 113.3° | 109.5° |
| S1P | C2P | H22 | 113.4° | 109.4° |
| C2P | S1P | O1P | 107.8° | 100.0° |
| H21 | C2P | H22 | 97.2° | 109.5° |
| S1P | O1P | HOS1 | 107.7° | 106.8° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N1A | C2A | N3A | H2A | 180.0° | 179.9° |
| N1A | C2A | N3A | C4A | 0.0° | 0.3° |
| C2A | N1A | C6A | C5A | 1.1° | 0.0° |
| C2A | N1A | C6A | N6A | 170.1° | 180.0° |
| C6A | N1A | C2A | N3A | 0.5° | 0.0° |
| C6A | N1A | C2A | H2A | 179.5° | 179.9° |
| N1A | C6A | C5A | C4A | 1.4° | 0.3° |
| N1A | C6A | C5A | N6A | 171.2° | 180.0° |
| N1A | C6A | C5A | N7A | 178.3° | 179.9° |
| N1A | C6A | N6A | H61A | 180.0° | 0.0° |
| N1A | C6A | N6A | H62A | 54.7° | 180.0° |
| C2A | N3A | C4A | C5A | 0.2° | 0.6° |
| C2A | N3A | C4A | N9A | 177.8° | 179.6° |
| H2A | C2A | N3A | C4A | 180.0° | 179.8° |
| N3A | C4A | C5A | N9A | 178.6° | 179.2° |
| N3A | C4A | C5A | C6A | 0.9° | 0.6° |
| N3A | C4A | C5A | N7A | 178.2° | 179.7° |
| N3A | C4A | N9A | C8A | 177.1° | 179.5° |
| N3A | C4A | N9A | C1B | 17.3° | 0.8° |
| C4A | C5A | C6A | N7A | 176.9° | 179.7° |
| C4A | C5A | C6A | N6A | 169.8° | 179.7° |
| C4A | C5A | N7A | C8A | 0.3° | 0.3° |
| C5A | C4A | N9A | C8A | 1.0° | 0.4° |
| C5A | C4A | N9A | C1B | 164.5° | 179.9° |
| N9A | C4A | C5A | C6A | 177.7° | 179.8° |
| N9A | C4A | C5A | N7A | 0.4° | 0.4° |
| C4A | N9A | C8A | N7A | 1.3° | 0.3° |
| C4A | N9A | C8A | C1B | 165.4° | 179.7° |
| C4A | N9A | C8A | H8A | 178.7° | 179.8° |
| C4A | N9A | C1B | C2B | 119.2° | 94.1° |
| C4A | N9A | C1B | O4B | 121.8° | 151.8° |
| C4A | N9A | C1B | H1B | 2.9° | 28.9° |
| C5A | C6A | N6A | H61A | 9.4° | 180.0° |
| C5A | C6A | N6A | H62A | 115.9° | 0.0° |
| C6A | C5A | N7A | C8A | 176.9° | 180.0° |
| N7A | C5A | C6A | N6A | 7.1° | 0.1° |
| C5A | N7A | C8A | N9A | 1.0° | 0.0° |
| C5A | N7A | C8A | H8A | 179.0° | 180.0° |
| C6A | N6A | H61A | H62A | 125.3° | 180.0° |
| N7A | C8A | N9A | H8A | 180.0° | 180.0° |
| N7A | C8A | N9A | C1B | 164.1° | 180.0° |
| C8A | N9A | C1B | C2B | 43.7° | 85.6° |
| C8A | N9A | C1B | O4B | 75.3° | 28.6° |
| C8A | N9A | C1B | H1B | 165.8° | 151.5° |
| H8A | C8A | N9A | C1B | 15.9° | 0.1° |
| N9A | C1B | C2B | O4B | 123.5° | 118.6° |
| N9A | C1B | C2B | H1B | 117.5° | 122.9° |
| N9A | C1B | O4B | H1B | 117.4° | 122.9° |
| N9A | C1B | C2B | O2B | 68.4° | 86.2° |
| N9A | C1B | C2B | C3B | 163.2° | 155.6° |
| N9A | C1B | C2B | H2B | 40.8° | 37.4° |
| N9A | C1B | O4B | C4B | 143.2° | 158.7° |
| C2B | C1B | O4B | H1B | 122.1° | 118.5° |
| C1B | C2B | O2B | C3B | 119.5° | 112.7° |
| C1B | C2B | O2B | H2B | 119.9° | 123.7° |
| C1B | C2B | C3B | H2B | 121.8° | 118.2° |
| C1B | C2B | O2B | HO2A | 180.0° | 61.5° |
| C1B | C2B | C3B | O3B | 83.4° | 97.9° |
| C1B | C2B | C3B | C4B | 39.5° | 21.0° |
| C1B | C2B | C3B | H3B | 161.8° | 139.5° |
| C2B | C1B | O4B | C4B | 22.8° | 40.0° |
| O4B | C1B | C2B | O2B | 168.1° | 155.3° |
| O4B | C1B | C2B | C3B | 39.8° | 37.1° |
| O4B | C1B | C2B | H2B | 82.6° | 81.1° |
| C1B | O4B | C4B | C3B | 3.7° | 26.4° |
| C1B | O4B | C4B | C5B | 101.9° | 146.0° |
| C1B | O4B | C4B | H4B | 130.8° | 93.1° |
| H1B | C1B | C2B | O2B | 49.0° | 36.8° |
| H1B | C1B | C2B | C3B | 79.3° | 81.4° |
| H1B | C1B | C2B | H2B | 158.3° | 160.4° |
| H1B | C1B | O4B | C4B | 99.4° | 78.4° |
| O2B | C2B | C3B | H2B | 109.4° | 123.6° |
| O2B | C2B | C3B | O3B | 45.4° | 20.3° |
| O2B | C2B | C3B | C4B | 168.3° | 139.2° |
| O2B | C2B | C3B | H3B | 69.3° | 102.3° |
| C3B | C2B | O2B | HO2A | 60.5° | 174.2° |
| C2B | C3B | O3B | C4B | 115.4° | 114.7° |
| C2B | C3B | O3B | H3B | 122.3° | 122.6° |
| C2B | C3B | C4B | H3B | 122.5° | 118.6° |
| C2B | C3B | O3B | P3B | 166.1° | 121.5° |
| C2B | C3B | C4B | O4B | 28.4° | 1.9° |
| C2B | C3B | C4B | C5B | 84.8° | 121.4° |
| C2B | C3B | C4B | H4B | 149.7° | 117.6° |
| H2B | C2B | O2B | HO2A | 60.1° | 62.2° |
| H2B | C2B | C3B | O3B | 154.8° | 143.9° |
| H2B | C2B | C3B | C4B | 82.3° | 97.2° |
| H2B | C2B | C3B | H3B | 40.0° | 21.3° |
| O3B | C3B | C4B | H3B | 114.8° | 122.7° |
| C3B | O3B | P3B | O7A | 59.1° | 60.0° |
| C3B | O3B | P3B | O8A | 63.8° | 180.0° |
| C3B | O3B | P3B | O9A | 178.6° | 60.0° |
| O3B | C3B | C4B | O4B | 94.3° | 120.6° |
| O3B | C3B | C4B | C5B | 152.5° | 119.9° |
| O3B | C3B | C4B | H4B | 27.0° | 1.1° |
| C4B | C3B | O3B | P3B | 78.5° | 123.8° |
| C3B | C4B | O4B | C5B | 105.6° | 119.5° |
| C3B | C4B | O4B | H4B | 127.1° | 119.5° |
| C3B | C4B | C5B | H4B | 125.3° | 121.0° |
| C3B | C4B | C5B | O5B | 171.7° | 179.7° |
| C3B | C4B | C5B | H51A | 63.0° | 59.7° |
| C3B | C4B | C5B | H52A | 46.4° | 60.3° |
| H3B | C3B | O3B | P3B | 43.7° | 1.1° |
| H3B | C3B | C4B | O4B | 150.8° | 116.6° |
| H3B | C3B | C4B | C5B | 37.6° | 2.9° |
| H3B | C3B | C4B | H4B | 87.9° | 123.8° |
| O3B | P3B | O7A | O8A | 115.1° | 120.0° |
| O3B | P3B | O7A | O9A | 111.7° | 120.0° |
| O3B | P3B | O8A | O9A | 109.5° | 120.0° |
| O3B | P3B | O8A | HOA8 | 180.0° | 180.0° |
| O3B | P3B | O9A | HOA9 | 180.0° | 60.0° |
| O7A | P3B | O8A | O9A | 133.4° | 120.0° |
| O7A | P3B | O8A | HOA8 | 62.9° | 60.0° |
| O7A | P3B | O9A | HOA9 | 65.1° | 180.0° |
| O8A | P3B | O9A | HOA9 | 69.3° | 60.0° |
| O9A | P3B | O8A | HOA8 | 70.4° | 60.0° |
| O4B | C4B | C5B | H4B | 121.3° | 121.0° |
| O4B | C4B | C5B | O5B | 58.4° | 61.7° |
| O4B | C4B | C5B | H51A | 176.3° | 58.3° |
| O4B | C4B | C5B | H52A | 66.9° | 178.3° |
| C4B | C5B | O5B | H51A | 125.3° | 120.0° |
| C4B | C5B | O5B | H52A | 125.3° | 120.0° |
| C4B | C5B | H51A | H52A | 114.4° | 120.0° |
| C4B | C5B | O5B | P1A | 176.2° | 180.0° |
| H4B | C4B | C5B | O5B | 63.0° | 59.3° |
| H4B | C4B | C5B | H51A | 62.3° | 179.3° |
| H4B | C4B | C5B | H52A | 171.8° | 60.7° |
| O5B | C5B | H51A | H52A | 114.5° | 120.0° |
| C5B | O5B | P1A | O1A | 169.7° | 60.0° |
| C5B | O5B | P1A | O2A | 60.0° | 60.0° |
| C5B | O5B | P1A | O3A | 54.1° | 180.0° |
| H51A | C5B | O5B | P1A | 58.5° | 60.0° |
| H52A | C5B | O5B | P1A | 51.0° | 60.0° |
| O5B | P1A | O1A | O2A | 126.2° | 120.0° |
| O5B | P1A | O1A | O3A | 108.1° | 120.0° |
| O5B | P1A | O2A | O3A | 108.0° | 120.0° |
| O5B | P1A | O2A | HOA2 | 180.0° | 60.1° |
| O5B | P1A | O3A | P2A | 160.5° | 180.0° |
| O1A | P1A | O2A | O3A | 126.6° | 120.0° |
| O1A | P1A | O2A | HOA2 | 54.6° | 180.0° |
| O1A | P1A | O3A | P2A | 46.3° | 60.0° |
| O2A | P1A | O3A | P2A | 84.2° | 60.0° |
| O3A | P1A | O2A | HOA2 | 72.0° | 60.0° |
| P1A | O3A | P2A | O4A | 81.6° | 60.1° |
| P1A | O3A | P2A | O5A | 149.0° | 60.0° |
| P1A | O3A | P2A | O6A | 32.4° | 180.0° |
| O3A | P2A | O4A | O5A | 120.8° | 120.0° |
| O3A | P2A | O4A | O6A | 110.8° | 119.9° |
| O3A | P2A | O5A | O6A | 109.7° | 120.0° |
| O3A | P2A | O5A | HOA5 | 180.0° | 60.0° |
| O3A | P2A | O6A | CCP | 165.7° | 180.0° |
| O4A | P2A | O5A | O6A | 126.4° | 120.0° |
| O4A | P2A | O5A | HOA5 | 56.2° | 180.0° |
| O4A | P2A | O6A | CCP | 78.1° | 60.1° |
| O5A | P2A | O6A | CCP | 54.6° | 60.0° |
| O6A | P2A | O5A | HOA5 | 70.3° | 60.0° |
| P2A | O6A | CCP | CBP | 171.4° | 180.0° |
| P2A | O6A | CCP | H121 | 46.1° | 60.0° |
| P2A | O6A | CCP | H122 | 63.4° | 60.0° |
| O6A | CCP | CBP | H121 | 125.2° | 120.0° |
| O6A | CCP | CBP | H122 | 125.3° | 119.9° |
| O6A | CCP | CBP | CDP | 69.3° | 60.0° |
| O6A | CCP | CBP | CEP | 175.6° | 60.0° |
| O6A | CCP | CBP | CAP | 55.0° | 180.0° |
| O6A | CCP | H121 | H122 | 115.3° | 120.0° |
| CCP | CBP | CDP | CEP | 112.8° | 120.0° |
| CCP | CBP | CDP | CAP | 125.7° | 120.0° |
| CCP | CBP | CEP | CAP | 121.1° | 120.0° |
| CBP | CCP | H121 | H122 | 115.4° | 120.0° |
| CCP | CBP | CDP | H131 | 180.0° | 53.0° |
| CCP | CBP | CDP | H132 | 54.7° | 67.0° |
| CCP | CBP | CDP | H133 | 54.7° | 173.0° |
| CCP | CBP | CEP | H141 | 180.0° | 63.8° |
| CCP | CBP | CEP | H142 | 54.7° | 176.2° |
| CCP | CBP | CEP | H143 | 54.7° | 56.2° |
| CCP | CBP | CAP | OAP | 87.0° | 65.9° |
| CCP | CBP | CAP | C9P | 149.4° | 54.0° |
| CCP | CBP | CAP | H10 | 34.8° | 174.1° |
| CDP | CBP | CEP | CAP | 120.4° | 120.0° |
| CDP | CBP | CCP | H121 | 55.9° | 60.0° |
| CDP | CBP | CCP | H122 | 165.4° | 180.0° |
| CBP | CDP | H131 | H132 | 125.2° | 120.0° |
| CBP | CDP | H131 | H133 | 125.3° | 119.9° |
| CBP | CDP | H132 | H133 | 117.1° | 119.9° |
| CDP | CBP | CEP | H141 | 61.5° | 176.2° |
| CDP | CBP | CEP | H142 | 63.8° | 56.2° |
| CDP | CBP | CEP | H143 | 173.2° | 63.8° |
| CDP | CBP | CAP | OAP | 38.5° | 174.1° |
| CDP | CBP | CAP | C9P | 85.2° | 65.9° |
| CDP | CBP | CAP | H10 | 160.3° | 54.1° |
| CEP | CBP | CCP | H121 | 59.2° | 180.0° |
| CEP | CBP | CCP | H122 | 50.3° | 60.0° |
| CEP | CBP | CDP | H131 | 67.2° | 173.0° |
| CEP | CBP | CDP | H132 | 167.5° | 53.0° |
| CEP | CBP | CDP | H133 | 58.1° | 67.0° |
| CBP | CEP | H141 | H142 | 125.3° | 120.1° |
| CBP | CEP | H141 | H143 | 125.2° | 120.0° |
| CBP | CEP | H142 | H143 | 120.3° | 120.0° |
| CEP | CBP | CAP | OAP | 157.3° | 54.1° |
| CEP | CBP | CAP | C9P | 33.6° | 174.1° |
| CEP | CBP | CAP | H10 | 80.9° | 65.9° |
| CAP | CBP | CCP | H121 | 179.8° | 60.0° |
| CAP | CBP | CCP | H122 | 70.3° | 60.1° |
| CAP | CBP | CDP | H131 | 54.3° | 67.0° |
| CAP | CBP | CDP | H132 | 71.0° | 173.0° |
| CAP | CBP | CDP | H133 | 179.6° | 53.0° |
| CAP | CBP | CEP | H141 | 58.9° | 56.2° |
| CAP | CBP | CEP | H142 | 175.8° | 63.8° |
| CAP | CBP | CEP | H143 | 66.4° | 176.2° |
| CBP | CAP | OAP | C9P | 129.5° | 120.0° |
| CBP | CAP | OAP | H10 | 114.8° | 120.0° |
| CBP | CAP | C9P | H10 | 113.8° | 120.0° |
| CBP | CAP | OAP | HO1 | 180.0° | 60.0° |
| CBP | CAP | C9P | O9P | 92.9° | 109.1° |
| CBP | CAP | C9P | N8P | 92.8° | 70.9° |
| H131 | CDP | H132 | H133 | 117.3° | 120.1° |
| H141 | CEP | H142 | H143 | 120.4° | 119.9° |
| OAP | CAP | C9P | H10 | 121.9° | 120.0° |
| OAP | CAP | C9P | O9P | 31.3° | 10.8° |
| OAP | CAP | C9P | N8P | 142.9° | 169.2° |
| C9P | CAP | OAP | HO1 | 50.5° | 60.0° |
| CAP | C9P | O9P | N8P | 174.1° | 180.0° |
| CAP | C9P | N8P | C7P | 178.4° | 176.3° |
| CAP | C9P | N8P | HN8 | 1.5° | 3.7° |
| H10 | CAP | OAP | HO1 | 65.2° | 180.0° |
| H10 | CAP | C9P | O9P | 153.3° | 130.8° |
| H10 | CAP | C9P | N8P | 21.0° | 49.2° |
| O9P | C9P | N8P | C7P | 3.9° | 3.7° |
| O9P | C9P | N8P | HN8 | 176.0° | 176.3° |
| C9P | N8P | C7P | HN8 | 180.0° | 180.0° |
| C9P | N8P | C7P | C6P | 154.6° | 180.0° |
| C9P | N8P | C7P | H71 | 80.2° | 60.0° |
| C9P | N8P | C7P | H72 | 29.3° | 59.9° |
| N8P | C7P | C6P | H71 | 125.2° | 120.0° |
| N8P | C7P | C6P | H72 | 125.2° | 120.0° |
| N8P | C7P | H71 | H72 | 115.9° | 120.0° |
| N8P | C7P | C6P | C5P | 169.8° | 180.0° |
| N8P | C7P | C6P | H61 | 64.9° | 59.9° |
| N8P | C7P | C6P | H62 | 44.6° | 60.0° |
| HN8 | N8P | C7P | C6P | 25.4° | 0.0° |
| HN8 | N8P | C7P | H71 | 99.8° | 120.0° |
| HN8 | N8P | C7P | H72 | 150.7° | 120.0° |
| C6P | C7P | H71 | H72 | 115.9° | 120.0° |
| C7P | C6P | C5P | H61 | 125.3° | 120.1° |
| C7P | C6P | C5P | H62 | 125.2° | 120.0° |
| C7P | C6P | H61 | H62 | 117.5° | 120.0° |
| C7P | C6P | C5P | O5P | 3.0° | 0.0° |
| C7P | C6P | C5P | N4P | 179.5° | 180.0° |
| H71 | C7P | C6P | C5P | 44.6° | 59.9° |
| H71 | C7P | C6P | H61 | 169.9° | 180.0° |
| H71 | C7P | C6P | H62 | 80.6° | 60.1° |
| H72 | C7P | C6P | C5P | 64.9° | 60.0° |
| H72 | C7P | C6P | H61 | 60.4° | 60.1° |
| H72 | C7P | C6P | H62 | 169.8° | 180.0° |
| C5P | C6P | H61 | H62 | 117.5° | 120.0° |
| C6P | C5P | O5P | N4P | 177.7° | 179.9° |
| C6P | C5P | N4P | C3P | 177.3° | 180.0° |
| C6P | C5P | N4P | HN4 | 2.7° | 0.1° |
| H61 | C6P | C5P | O5P | 128.3° | 120.0° |
| H61 | C6P | C5P | N4P | 54.2° | 59.9° |
| H62 | C6P | C5P | O5P | 122.2° | 120.0° |
| H62 | C6P | C5P | N4P | 55.3° | 60.0° |
| O5P | C5P | N4P | C3P | 5.2° | 0.1° |
| O5P | C5P | N4P | HN4 | 174.8° | 180.0° |
| C5P | N4P | C3P | HN4 | 180.0° | 179.9° |
| C5P | N4P | C3P | C2P | 150.9° | 180.0° |
| C5P | N4P | C3P | H31 | 83.8° | 59.9° |
| C5P | N4P | C3P | H32 | 25.6° | 60.1° |
| N4P | C3P | C2P | H31 | 125.2° | 120.0° |
| N4P | C3P | C2P | H32 | 125.3° | 119.9° |
| N4P | C3P | H31 | H32 | 115.0° | 120.0° |
| N4P | C3P | C2P | S1P | 90.0° | 180.0° |
| N4P | C3P | C2P | H21 | 144.7° | 60.0° |
| N4P | C3P | C2P | H22 | 35.2° | 60.1° |
| HN4 | N4P | C3P | C2P | 29.1° | 0.1° |
| HN4 | N4P | C3P | H31 | 96.1° | 120.0° |
| HN4 | N4P | C3P | H32 | 154.4° | 120.0° |
| C2P | C3P | H31 | H32 | 115.2° | 120.0° |
| C3P | C2P | S1P | H21 | 125.3° | 120.0° |
| C3P | C2P | S1P | H22 | 125.2° | 119.9° |
| C3P | C2P | H21 | H22 | 119.2° | 120.0° |
| C3P | C2P | S1P | O1P | 163.3° | 180.0° |
| H31 | C3P | C2P | S1P | 35.2° | 60.0° |
| H31 | C3P | C2P | H21 | 90.1° | 180.0° |
| H31 | C3P | C2P | H22 | 160.4° | 59.9° |
| H32 | C3P | C2P | S1P | 144.7° | 60.0° |
| H32 | C3P | C2P | H21 | 19.4° | 60.0° |
| H32 | C3P | C2P | H22 | 90.1° | 180.0° |
| S1P | C2P | H21 | H22 | 119.3° | 120.0° |
| C2P | S1P | O1P | HOS1 | 179.9° | 180.0° |
| H21 | C2P | S1P | O1P | 71.5° | 60.0° |
| H22 | C2P | S1P | O1P | 38.1° | 60.1° |
